COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK591802
Chemical Name: dimethyl7-(2-hydroxy-5-nitrophenyl)-2-oxo-3,7-dihydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylate
Smiles: COC(=O)C1=C(Sc2c(C1c1cc(ccc1O)[N+](=O)[O-])sc(=O)[nH]2)C(=O)OC

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Molecular Weight: 424.41
Empirical Formula: C16H12N2O8S2

Physical State: Dry powder
Available Amount: 3 mg

Lipinsky:
logP: 2.949
Rotatable bonds: 6
H-donors: 2
H-acceptors: 8
PSA: 198
Number of rings: 3

     

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